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dimethyl 5-{[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetyl]amino}isophthalate
SpectraBase Compound ID Eevm7jLVnMo
InChI InChI=1S/C20H18N2O6S/c1-27-19(25)11-7-12(20(26)28-2)9-13(8-11)21-17(23)10-16-18(24)22-14-5-3-4-6-15(14)29-16/h3-9,16H,10H2,1-2H3,(H,21,23)(H,22,24)
InChIKey CAQZNWWQKPNNST-UHFFFAOYSA-N
Mol Weight 414.43 g/mol
Molecular Formula C20H18N2O6S
Exact Mass 414.088557 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1JjeGPLUF0y
Name dimethyl 5-{[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetyl]amino}isophthalate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H18N2O6S/c1-27-19(25)11-7-12(20(26)28-2)9-13(8-11)21-17(23)10-16-18(24)22-14-5-3-4-6-15(14)29-16/h3-9,16H,10H2,1-2H3,(H,21,23)(H,22,24)
InChIKey CAQZNWWQKPNNST-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7037
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D27369; Labnumber: VGU-18621; SBI_ID: SBI-007040
Temperature 315 °C